data_nef_c25568_2n1n save_entry_information _nef_nmr_meta_data.sf_category nef_nmr_meta_data _nef_nmr_meta_data.sf_framecode entry_information _nef_nmr_meta_data.format_name nmr_exchange_format _nef_nmr_meta_data.format_version 1.1 loop_ _nef_related_entries.database_name _nef_related_entries.database_accession_code PDB 1S6X PDB 2N1N stop_ save_ save_assembly _nef_molecular_system.sf_category nef_molecular_system _nef_molecular_system.sf_framecode assembly loop_ _nef_covalent_links.chain_code_1 _nef_covalent_links.sequence_code_1 _nef_covalent_links.residue_name_1 _nef_covalent_links.atom_name_1 _nef_covalent_links.chain_code_2 _nef_covalent_links.sequence_code_2 _nef_covalent_links.residue_name_2 _nef_covalent_links.atom_name_2 1 3 CYS SG 1 17 CYS SG 1 10 CYS SG 1 22 CYS SG 1 16 CYS SG 1 29 CYS SG stop_ loop_ _nef_sequence.index _nef_sequence.chain_code _nef_sequence.sequence_code _nef_sequence.residue_name _nef_sequence.linking _nef_sequence.residue_variant _nef_sequence.cis_peptide 1 A 1 SER start . . 2 A 2 GLU middle . . 3 A 3 CYS middle -HG . 4 A 4 GLY middle . false 5 A 5 LYS middle . . 6 A 6 PHE middle . . 7 A 7 MET middle . . 8 A 8 TRP middle . . 9 A 9 LYS middle . . 10 A 10 CYS middle -HG . 11 A 11 LYS middle . . 12 A 12 ASN middle . . 13 A 13 SER middle . . 14 A 14 ASN middle . . 15 A 15 ASP middle . . 16 A 16 CYS middle -HG . 17 A 17 CYS middle -HG . 18 A 18 LYS middle . . 19 A 19 ASP middle . . 20 A 20 LEU middle . . 21 A 21 VAL middle . . 22 A 22 CYS middle -HG . 23 A 23 SER middle . . 24 A 24 SER middle . . 25 A 25 ARG middle . . 26 A 26 TRP middle . . 27 A 27 LYS middle . . 28 A 28 TRP middle . . 29 A 29 CYS middle -HG . 30 A 30 VAL middle . . 31 A 31 LEU middle . . 32 A 32 ALA middle . . 33 A 33 SER middle . . 34 A 34 PRO middle . false 35 A 35 PHE end . . stop_ save_ save_assigned_chem_shift_list_1 _nef_chemical_shift_list.sf_category nef_chemical_shift_list _nef_chemical_shift_list.sf_framecode assigned_chem_shift_list_1 loop_ _nef_chemical_shift.chain_code _nef_chemical_shift.sequence_code _nef_chemical_shift.residue_name _nef_chemical_shift.atom_name _nef_chemical_shift.element _nef_chemical_shift.isotope_number _nef_chemical_shift.value _nef_chemical_shift.value_uncertainty A 1 SER HA H 1 4.183 0.03 A 1 SER HBy H 1 4.017 0.03 A 1 SER HBx H 1 3.957 0.03 A 1 SER C C 13 168.928 0.3 A 1 SER CA C 13 57.390 0.3 A 1 SER CB C 13 63.065 0.3 A 2 GLU H H 1 8.802 0.03 A 2 GLU HA H 1 4.501 0.03 A 2 GLU HBy H 1 2.128 0.03 A 2 GLU HBx H 1 2.019 0.03 A 2 GLU HGx H 1 2.362 0.03 A 2 GLU HGy H 1 2.362 0.03 A 2 GLU C C 13 173.747 0.3 A 2 GLU CA C 13 56.086 0.3 A 2 GLU CB C 13 30.592 0.3 A 2 GLU CG C 13 35.515 0.3 A 2 GLU N N 15 121.648 0.2 A 3 CYS H H 1 8.252 0.03 A 3 CYS HA H 1 4.568 0.03 A 3 CYS HBx H 1 2.821 0.03 A 3 CYS HBy H 1 3.073 0.03 A 3 CYS C C 13 171.833 0.3 A 3 CYS CA C 13 54.337 0.3 A 3 CYS CB C 13 41.809 0.3 A 3 CYS N N 15 119.267 0.2 A 4 GLY H H 1 8.642 0.03 A 4 GLY HAx H 1 3.886 0.03 A 4 GLY HAy H 1 3.886 0.03 A 4 GLY CA C 13 46.766 0.3 A 4 GLY N N 15 107.188 0.2 A 5 LYS H H 1 5.250 0.03 A 5 LYS HA H 1 3.978 0.03 A 5 LYS HBx H 1 0.506 0.03 A 5 LYS HBy H 1 1.740 0.03 A 5 LYS HDy H 1 1.410 0.03 A 5 LYS HDx H 1 1.352 0.03 A 5 LYS HEy H 1 2.860 0.03 A 5 LYS HEx H 1 2.799 0.03 A 5 LYS HGy H 1 0.936 0.03 A 5 LYS HGx H 1 0.786 0.03 A 5 LYS C C 13 172.710 0.3 A 5 LYS CA C 13 54.483 0.3 A 5 LYS CB C 13 32.688 0.3 A 5 LYS CD C 13 29.281 0.3 A 5 LYS CE C 13 42.216 0.3 A 5 LYS CG C 13 25.423 0.3 A 5 LYS N N 15 124.281 0.2 A 6 PHE H H 1 8.141 0.03 A 6 PHE HA H 1 4.077 0.03 A 6 PHE HBy H 1 3.104 0.03 A 6 PHE HBx H 1 2.771 0.03 A 6 PHE HDx H 1 7.281 0.03 A 6 PHE HDy H 1 7.281 0.03 A 6 PHE HEx H 1 7.470 0.03 A 6 PHE HEy H 1 7.470 0.03 A 6 PHE HZ H 1 7.326 0.03 A 6 PHE C C 13 174.609 0.3 A 6 PHE CA C 13 59.363 0.3 A 6 PHE CB C 13 38.968 0.3 A 6 PHE CDx C 13 131.744 0.3 A 6 PHE CEx C 13 131.545 0.3 A 6 PHE CZ C 13 130.000 0.3 A 6 PHE N N 15 119.437 0.2 A 7 MET H H 1 9.152 0.03 A 7 MET HA H 1 2.968 0.03 A 7 MET HBy H 1 1.630 0.03 A 7 MET HBx H 1 1.450 0.03 A 7 MET HE% H 1 1.131 0.03 A 7 MET HGx H 1 0.288 0.03 A 7 MET HGy H 1 0.654 0.03 A 7 MET C C 13 174.035 0.3 A 7 MET CA C 13 58.125 0.3 A 7 MET CB C 13 29.062 0.3 A 7 MET CE C 13 15.688 0.3 A 7 MET CG C 13 31.668 0.3 A 7 MET N N 15 118.789 0.2 A 8 TRP H H 1 8.796 0.03 A 8 TRP HA H 1 4.626 0.03 A 8 TRP HBx H 1 3.309 0.03 A 8 TRP HBy H 1 3.410 0.03 A 8 TRP HD1 H 1 7.098 0.03 A 8 TRP HE1 H 1 10.343 0.03 A 8 TRP HE3 H 1 7.854 0.03 A 8 TRP HH2 H 1 7.296 0.03 A 8 TRP HZ2 H 1 7.549 0.03 A 8 TRP HZ3 H 1 7.170 0.03 A 8 TRP C C 13 174.497 0.3 A 8 TRP CA C 13 57.397 0.3 A 8 TRP CB C 13 28.697 0.3 A 8 TRP CD1 C 13 126.332 0.3 A 8 TRP CE3 C 13 121.196 0.3 A 8 TRP CH2 C 13 125.285 0.3 A 8 TRP CZ2 C 13 114.752 0.3 A 8 TRP CZ3 C 13 122.740 0.3 A 8 TRP N N 15 122.588 0.2 A 8 TRP NE1 N 15 130.578 0.2 A 9 LYS H H 1 8.289 0.03 A 9 LYS HA H 1 4.639 0.03 A 9 LYS HBx H 1 1.847 0.03 A 9 LYS HBy H 1 1.918 0.03 A 9 LYS HDx H 1 1.801 0.03 A 9 LYS HDy H 1 1.801 0.03 A 9 LYS HEx H 1 3.097 0.03 A 9 LYS HEy H 1 3.097 0.03 A 9 LYS HGy H 1 1.657 0.03 A 9 LYS HGx H 1 1.605 0.03 A 9 LYS C C 13 173.588 0.3 A 9 LYS CA C 13 57.251 0.3 A 9 LYS CB C 13 32.559 0.3 A 9 LYS CD C 13 28.893 0.3 A 9 LYS CE C 13 42.073 0.3 A 9 LYS CG C 13 24.739 0.3 A 9 LYS N N 15 121.982 0.2 A 10 CYS H H 1 8.131 0.03 A 10 CYS HA H 1 5.000 0.03 A 10 CYS HBx H 1 3.274 0.03 A 10 CYS HBy H 1 3.274 0.03 A 10 CYS C C 13 170.732 0.3 A 10 CYS CA C 13 53.609 0.3 A 10 CYS CB C 13 47.345 0.3 A 10 CYS N N 15 115.637 0.2 A 11 LYS H H 1 9.543 0.03 A 11 LYS HA H 1 4.429 0.03 A 11 LYS HBx H 1 1.860 0.03 A 11 LYS HBy H 1 1.860 0.03 A 11 LYS HDx H 1 1.715 0.03 A 11 LYS HDy H 1 1.715 0.03 A 11 LYS HEx H 1 3.003 0.03 A 11 LYS HEy H 1 3.003 0.03 A 11 LYS HGy H 1 1.489 0.03 A 11 LYS HGx H 1 1.417 0.03 A 11 LYS C C 13 174.737 0.3 A 11 LYS CA C 13 57.470 0.3 A 11 LYS CB C 13 34.015 0.3 A 11 LYS CD C 13 29.071 0.3 A 11 LYS CE C 13 41.886 0.3 A 11 LYS CG C 13 24.994 0.3 A 11 LYS N N 15 119.567 0.2 A 12 ASN H H 1 8.125 0.03 A 12 ASN HA H 1 4.723 0.03 A 12 ASN HBy H 1 3.004 0.03 A 12 ASN HBx H 1 2.962 0.03 A 12 ASN HD2y H 1 7.715 0.03 A 12 ASN HD2x H 1 6.959 0.03 A 12 ASN C C 13 174.896 0.3 A 12 ASN CA C 13 52.079 0.3 A 12 ASN CB C 13 40.935 0.3 A 12 ASN N N 15 115.051 0.2 A 12 ASN ND2 N 15 114.531 0.2 A 13 SER H H 1 9.317 0.03 A 13 SER HA H 1 4.116 0.03 A 13 SER HBy H 1 4.170 0.03 A 13 SER HBx H 1 4.052 0.03 A 13 SER C C 13 173.269 0.3 A 13 SER CA C 13 63.151 0.3 A 13 SER CB C 13 62.968 0.3 A 13 SER N N 15 117.741 0.2 A 14 ASN H H 1 8.579 0.03 A 14 ASN HA H 1 4.648 0.03 A 14 ASN HBy H 1 2.922 0.03 A 14 ASN HBx H 1 2.876 0.03 A 14 ASN HD2y H 1 7.588 0.03 A 14 ASN HD2x H 1 6.949 0.03 A 14 ASN C C 13 174.242 0.3 A 14 ASN CA C 13 55.139 0.3 A 14 ASN CB C 13 37.439 0.3 A 14 ASN N N 15 119.511 0.2 A 14 ASN ND2 N 15 112.906 0.2 A 15 ASP H H 1 7.797 0.03 A 15 ASP HA H 1 4.687 0.03 A 15 ASP HBy H 1 3.131 0.03 A 15 ASP HBx H 1 3.037 0.03 A 15 ASP C C 13 175.614 0.3 A 15 ASP CA C 13 55.721 0.3 A 15 ASP CB C 13 42.465 0.3 A 15 ASP N N 15 116.823 0.2 A 16 CYS H H 1 7.816 0.03 A 16 CYS HA H 1 5.083 0.03 A 16 CYS HBx H 1 2.791 0.03 A 16 CYS HBy H 1 3.205 0.03 A 16 CYS C C 13 172.327 0.3 A 16 CYS CA C 13 53.682 0.3 A 16 CYS CB C 13 41.809 0.3 A 16 CYS N N 15 118.609 0.2 A 17 CYS H H 1 9.560 0.03 A 17 CYS HA H 1 4.511 0.03 A 17 CYS HBy H 1 3.339 0.03 A 17 CYS HBx H 1 2.497 0.03 A 17 CYS C C 13 170.811 0.3 A 17 CYS CA C 13 54.483 0.3 A 17 CYS CB C 13 40.134 0.3 A 17 CYS N N 15 120.994 0.2 A 18 LYS H H 1 8.004 0.03 A 18 LYS HA H 1 4.052 0.03 A 18 LYS HBy H 1 1.805 0.03 A 18 LYS HBx H 1 1.690 0.03 A 18 LYS HDy H 1 1.710 0.03 A 18 LYS HDx H 1 1.649 0.03 A 18 LYS HEx H 1 3.003 0.03 A 18 LYS HEy H 1 3.003 0.03 A 18 LYS HGx H 1 1.431 0.03 A 18 LYS HGy H 1 1.431 0.03 A 18 LYS C C 13 174.322 0.3 A 18 LYS CA C 13 58.562 0.3 A 18 LYS CB C 13 32.631 0.3 A 18 LYS CD C 13 29.185 0.3 A 18 LYS CE C 13 42.251 0.3 A 18 LYS CG C 13 24.393 0.3 A 18 LYS N N 15 118.089 0.2 A 19 ASP H H 1 8.715 0.03 A 19 ASP HA H 1 4.295 0.03 A 19 ASP HBy H 1 3.143 0.03 A 19 ASP HBx H 1 2.882 0.03 A 19 ASP C C 13 172.790 0.3 A 19 ASP CA C 13 56.741 0.3 A 19 ASP CB C 13 38.677 0.3 A 19 ASP N N 15 116.375 0.2 A 20 LEU H H 1 8.286 0.03 A 20 LEU HA H 1 5.229 0.03 A 20 LEU HBy H 1 2.052 0.03 A 20 LEU HBx H 1 1.506 0.03 A 20 LEU HD1% H 1 1.508 0.03 A 20 LEU HD2% H 1 0.830 0.03 A 20 LEU HG H 1 0.788 0.03 A 20 LEU C C 13 173.971 0.3 A 20 LEU CA C 13 54.920 0.3 A 20 LEU CB C 13 44.577 0.3 A 20 LEU CDy C 13 28.257 0.3 A 20 LEU CDx C 13 26.867 0.3 A 20 LEU CG C 13 25.105 0.3 A 20 LEU N N 15 120.437 0.2 A 21 VAL H H 1 9.324 0.03 A 21 VAL HA H 1 4.579 0.03 A 21 VAL HB H 1 2.049 0.03 A 21 VAL HG1% H 1 0.888 0.03 A 21 VAL HG2% H 1 0.720 0.03 A 21 VAL C C 13 172.790 0.3 A 21 VAL CA C 13 58.999 0.3 A 21 VAL CB C 13 35.836 0.3 A 21 VAL CGy C 13 21.968 0.3 A 21 VAL CGx C 13 18.790 0.3 A 21 VAL N N 15 112.441 0.2 A 22 CYS H H 1 8.806 0.03 A 22 CYS HA H 1 4.806 0.03 A 22 CYS HBx H 1 2.495 0.03 A 22 CYS HBy H 1 2.703 0.03 A 22 CYS C C 13 173.348 0.3 A 22 CYS CA C 13 54.629 0.3 A 22 CYS CB C 13 39.843 0.3 A 22 CYS N N 15 121.656 0.2 A 23 SER H H 1 8.391 0.03 A 23 SER HA H 1 4.397 0.03 A 23 SER HBx H 1 3.914 0.03 A 23 SER HBy H 1 4.389 0.03 A 23 SER C C 13 175.215 0.3 A 23 SER CA C 13 58.271 0.3 A 23 SER CB C 13 63.442 0.3 A 23 SER N N 15 124.577 0.2 A 24 SER H H 1 9.050 0.03 A 24 SER HA H 1 4.129 0.03 A 24 SER HBy H 1 3.880 0.03 A 24 SER HBx H 1 3.854 0.03 A 24 SER C C 13 172.950 0.3 A 24 SER CA C 13 60.747 0.3 A 24 SER CB C 13 62.430 0.3 A 24 SER N N 15 126.697 0.2 A 25 ARG H H 1 7.499 0.03 A 25 ARG HA H 1 3.867 0.03 A 25 ARG HBy H 1 1.249 0.03 A 25 ARG HBx H 1 0.692 0.03 A 25 ARG HDy H 1 2.546 0.03 A 25 ARG HDx H 1 2.333 0.03 A 25 ARG HE H 1 6.567 0.03 A 25 ARG HGx H 1 0.209 0.03 A 25 ARG HGy H 1 0.447 0.03 A 25 ARG C C 13 175.662 0.3 A 25 ARG CA C 13 57.542 0.3 A 25 ARG CB C 13 30.592 0.3 A 25 ARG CD C 13 42.594 0.3 A 25 ARG CG C 13 25.799 0.3 A 25 ARG N N 15 120.375 0.2 A 25 ARG NE N 15 110.875 0.2 A 26 TRP H H 1 7.098 0.03 A 26 TRP HA H 1 4.168 0.03 A 26 TRP HBy H 1 1.311 0.03 A 26 TRP HBx H 1 1.019 0.03 A 26 TRP HD1 H 1 6.885 0.03 A 26 TRP HE1 H 1 10.045 0.03 A 26 TRP HE3 H 1 7.223 0.03 A 26 TRP HH2 H 1 7.203 0.03 A 26 TRP HZ2 H 1 7.413 0.03 A 26 TRP HZ3 H 1 7.099 0.03 A 26 TRP C C 13 173.077 0.3 A 26 TRP CA C 13 56.158 0.3 A 26 TRP CB C 13 28.553 0.3 A 26 TRP CD1 C 13 126.954 0.3 A 26 TRP CE3 C 13 121.339 0.3 A 26 TRP CH2 C 13 124.664 0.3 A 26 TRP CZ2 C 13 114.425 0.3 A 26 TRP CZ3 C 13 121.556 0.3 A 26 TRP N N 15 115.667 0.2 A 26 TRP NE1 N 15 127.531 0.2 A 27 LYS H H 1 8.001 0.03 A 27 LYS HA H 1 3.881 0.03 A 27 LYS HBy H 1 2.225 0.03 A 27 LYS HBx H 1 2.065 0.03 A 27 LYS HDy H 1 1.646 0.03 A 27 LYS HDx H 1 1.604 0.03 A 27 LYS HEy H 1 3.011 0.03 A 27 LYS HEx H 1 2.940 0.03 A 27 LYS HGx H 1 1.195 0.03 A 27 LYS HGy H 1 1.316 0.03 A 27 LYS C C 13 173.971 0.3 A 27 LYS CA C 13 56.287 0.3 A 27 LYS CB C 13 27.169 0.3 A 27 LYS CD C 13 28.318 0.3 A 27 LYS CE C 13 42.492 0.3 A 27 LYS CG C 13 24.347 0.3 A 27 LYS N N 15 112.484 0.2 A 28 TRP H H 1 6.947 0.03 A 28 TRP HA H 1 5.581 0.03 A 28 TRP HBx H 1 2.608 0.03 A 28 TRP HBy H 1 3.130 0.03 A 28 TRP HD1 H 1 6.870 0.03 A 28 TRP HE1 H 1 9.895 0.03 A 28 TRP HE3 H 1 7.386 0.03 A 28 TRP HH2 H 1 6.726 0.03 A 28 TRP HZ2 H 1 6.565 0.03 A 28 TRP HZ3 H 1 7.037 0.03 A 28 TRP C C 13 175.710 0.3 A 28 TRP CA C 13 55.284 0.3 A 28 TRP CB C 13 30.519 0.3 A 28 TRP CD1 C 13 124.962 0.3 A 28 TRP CE3 C 13 120.692 0.3 A 28 TRP CH2 C 13 124.194 0.3 A 28 TRP CZ2 C 13 114.163 0.3 A 28 TRP CZ3 C 13 121.393 0.3 A 28 TRP N N 15 110.998 0.2 A 28 TRP NE1 N 15 128.953 0.2 A 29 CYS H H 1 9.113 0.03 A 29 CYS HA H 1 5.254 0.03 A 29 CYS HBy H 1 3.471 0.03 A 29 CYS HBx H 1 2.805 0.03 A 29 CYS C C 13 173.157 0.3 A 29 CYS CA C 13 56.596 0.3 A 29 CYS CB C 13 41.518 0.3 A 29 CYS N N 15 121.176 0.2 A 30 VAL H H 1 9.923 0.03 A 30 VAL HA H 1 5.139 0.03 A 30 VAL HB H 1 2.698 0.03 A 30 VAL HG1% H 1 1.394 0.03 A 30 VAL HG2% H 1 1.001 0.03 A 30 VAL C C 13 173.269 0.3 A 30 VAL CA C 13 59.800 0.3 A 30 VAL CB C 13 35.909 0.3 A 30 VAL CGy C 13 23.286 0.3 A 30 VAL CGx C 13 18.710 0.3 A 30 VAL N N 15 117.187 0.2 A 31 LEU H H 1 8.331 0.03 A 31 LEU HA H 1 4.406 0.03 A 31 LEU HBy H 1 1.664 0.03 A 31 LEU HBx H 1 1.607 0.03 A 31 LEU HD1% H 1 0.844 0.03 A 31 LEU HD2% H 1 0.844 0.03 A 31 LEU HG H 1 1.669 0.03 A 31 LEU C C 13 176.285 0.3 A 31 LEU CA C 13 56.668 0.3 A 31 LEU CB C 13 41.882 0.3 A 31 LEU CDx C 13 23.348 0.3 A 31 LEU CDy C 13 24.960 0.3 A 31 LEU CG C 13 27.661 0.3 A 31 LEU N N 15 120.354 0.2 A 32 ALA H H 1 8.366 0.03 A 32 ALA HA H 1 4.201 0.03 A 32 ALA HB% H 1 1.298 0.03 A 32 ALA C C 13 175.758 0.3 A 32 ALA CA C 13 52.881 0.3 A 32 ALA CB C 13 19.229 0.3 A 32 ALA N N 15 124.391 0.2 A 33 SER H H 1 8.188 0.03 A 33 SER HA H 1 4.763 0.03 A 33 SER HBy H 1 3.818 0.03 A 33 SER HBx H 1 3.778 0.03 A 33 SER CA C 13 56.062 0.3 A 33 SER CB C 13 63.765 0.3 A 33 SER N N 15 115.562 0.2 A 34 PRO HA H 1 4.387 0.03 A 34 PRO HBy H 1 2.156 0.03 A 34 PRO HBx H 1 1.817 0.03 A 34 PRO HDy H 1 3.697 0.03 A 34 PRO HDx H 1 3.624 0.03 A 34 PRO HGy H 1 1.932 0.03 A 34 PRO HGx H 1 1.741 0.03 A 34 PRO C C 13 173.907 0.3 A 34 PRO CA C 13 63.667 0.3 A 34 PRO CB C 13 31.736 0.3 A 34 PRO CD C 13 50.640 0.3 A 34 PRO CG C 13 26.837 0.3 A 35 PHE H H 1 7.482 0.03 A 35 PHE HA H 1 4.451 0.03 A 35 PHE HBy H 1 3.166 0.03 A 35 PHE HBx H 1 2.969 0.03 A 35 PHE HDx H 1 7.237 0.03 A 35 PHE HDy H 1 7.237 0.03 A 35 PHE HEx H 1 7.349 0.03 A 35 PHE HEy H 1 7.349 0.03 A 35 PHE HZ H 1 7.290 0.03 A 35 PHE CA C 13 58.718 0.3 A 35 PHE CB C 13 40.125 0.3 A 35 PHE CDy C 13 132.344 0.3 A 35 PHE CEy C 13 131.562 0.3 A 35 PHE CZ C 13 129.219 0.3 A 35 PHE N N 15 123.230 0.2 stop_ save_ save_DYANA/DIANA_distance_constraints_4 _nef_distance_restraint_list.sf_category nef_distance_restraint_list _nef_distance_restraint_list.sf_framecode DYANA/DIANA_distance_constraints_4 _nef_distance_restraint_list.restraint_origin undefined _nef_distance_restraint_list.potential_type upper-bound-parabolic loop_ _nef_distance_restraint.index _nef_distance_restraint.restraint_id _nef_distance_restraint.chain_code_1 _nef_distance_restraint.sequence_code_1 _nef_distance_restraint.residue_name_1 _nef_distance_restraint.atom_name_1 _nef_distance_restraint.chain_code_2 _nef_distance_restraint.sequence_code_2 _nef_distance_restraint.residue_name_2 _nef_distance_restraint.atom_name_2 _nef_distance_restraint.weight _nef_distance_restraint.lower_limit _nef_distance_restraint.upper_limit 1 1 A 3 CYS SG A 17 CYS SG 1.0 . 1.98 2 2 A 3 CYS SG A 17 CYS CB 1.0 . 2.90 3 3 A 17 CYS SG A 3 CYS CB 1.0 . 2.90 4 4 A 10 CYS SG A 22 CYS SG 1.0 . 1.98 5 5 A 10 CYS SG A 22 CYS CB 1.0 . 2.90 6 6 A 22 CYS SG A 10 CYS CB 1.0 . 2.90 7 7 A 16 CYS SG A 29 CYS SG 1.0 . 1.98 8 8 A 16 CYS SG A 29 CYS CB 1.0 . 2.90 9 9 A 29 CYS SG A 16 CYS CB 1.0 . 2.90 10 10 A 3 CYS SG A 17 CYS SG 1.0 . 2.12 11 11 A 3 CYS SG A 17 CYS CB 1.0 . 3.50 12 12 A 17 CYS SG A 3 CYS CB 1.0 . 3.50 13 13 A 10 CYS SG A 22 CYS SG 1.0 . 2.12 14 14 A 10 CYS SG A 22 CYS CB 1.0 . 3.50 15 15 A 22 CYS SG A 10 CYS CB 1.0 . 3.50 16 16 A 16 CYS SG A 29 CYS SG 1.0 . 2.12 17 17 A 16 CYS SG A 29 CYS CB 1.0 . 3.50 18 18 A 29 CYS SG A 16 CYS CB 1.0 . 3.50 stop_ save_ save_DYANA/DIANA_distance_constraints_3 _nef_distance_restraint_list.sf_category nef_distance_restraint_list _nef_distance_restraint_list.sf_framecode DYANA/DIANA_distance_constraints_3 _nef_distance_restraint_list.restraint_origin hbond _nef_distance_restraint_list.potential_type upper-bound-parabolic loop_ _nef_distance_restraint.index _nef_distance_restraint.restraint_id _nef_distance_restraint.chain_code_1 _nef_distance_restraint.sequence_code_1 _nef_distance_restraint.residue_name_1 _nef_distance_restraint.atom_name_1 _nef_distance_restraint.chain_code_2 _nef_distance_restraint.sequence_code_2 _nef_distance_restraint.residue_name_2 _nef_distance_restraint.atom_name_2 _nef_distance_restraint.weight _nef_distance_restraint.lower_limit _nef_distance_restraint.upper_limit 1 1 A 7 MET H A 29 CYS O 1.0 . 1.8 2 2 A 29 CYS O A 7 MET N 1.0 . 2.7 3 3 A 21 VAL O A 30 VAL H 1.0 . 1.8 4 4 A 21 VAL O A 30 VAL N 1.0 . 2.7 5 5 A 21 VAL H A 30 VAL O 1.0 . 1.8 6 6 A 30 VAL O A 21 VAL N 1.0 . 2.7 7 7 A 8 TRP O A 29 CYS H 1.0 . 1.8 8 8 A 8 TRP O A 29 CYS N 1.0 . 2.7 9 9 A 23 SER O A 27 LYS H 1.0 . 1.8 10 10 A 23 SER O A 27 LYS N 1.0 . 2.7 11 11 A 23 SER H A 28 TRP O 1.0 . 1.8 12 12 A 28 TRP O A 23 SER N 1.0 . 2.7 13 13 A 19 ASP O A 32 ALA H 1.0 . 1.8 14 14 A 19 ASP O A 32 ALA N 1.0 . 2.7 15 15 A 7 MET H A 29 CYS O 1.0 . 2.2 16 16 A 29 CYS O A 7 MET N 1.0 . 3.4 17 17 A 21 VAL O A 30 VAL H 1.0 . 2.2 18 18 A 21 VAL O A 30 VAL N 1.0 . 3.4 19 19 A 21 VAL H A 30 VAL O 1.0 . 2.2 20 20 A 30 VAL O A 21 VAL N 1.0 . 3.4 21 21 A 8 TRP O A 29 CYS H 1.0 . 2.2 22 22 A 8 TRP O A 29 CYS N 1.0 . 3.4 23 23 A 23 SER O A 27 LYS H 1.0 . 2.2 24 24 A 23 SER O A 27 LYS N 1.0 . 3.4 25 25 A 23 SER H A 28 TRP O 1.0 . 2.2 26 26 A 28 TRP O A 23 SER N 1.0 . 3.4 27 27 A 19 ASP O A 32 ALA H 1.0 . 2.2 28 28 A 19 ASP O A 32 ALA N 1.0 . 3.4 stop_ save_ save_DYANA/DIANA_dihedral_5 _nef_dihedral_restraint_list.sf_category nef_dihedral_restraint_list _nef_dihedral_restraint_list.sf_framecode DYANA/DIANA_dihedral_5 _nef_dihedral_restraint_list.potential_type square-well-parabolic _nef_dihedral_restraint_list.restraint_origin . loop_ _nef_dihedral_restraint.index _nef_dihedral_restraint.restraint_id _nef_dihedral_restraint.chain_code_1 _nef_dihedral_restraint.sequence_code_1 _nef_dihedral_restraint.residue_name_1 _nef_dihedral_restraint.atom_name_1 _nef_dihedral_restraint.chain_code_2 _nef_dihedral_restraint.sequence_code_2 _nef_dihedral_restraint.residue_name_2 _nef_dihedral_restraint.atom_name_2 _nef_dihedral_restraint.chain_code_3 _nef_dihedral_restraint.sequence_code_3 _nef_dihedral_restraint.residue_name_3 _nef_dihedral_restraint.atom_name_3 _nef_dihedral_restraint.chain_code_4 _nef_dihedral_restraint.sequence_code_4 _nef_dihedral_restraint.residue_name_4 _nef_dihedral_restraint.atom_name_4 _nef_dihedral_restraint.weight _nef_dihedral_restraint.lower_limit _nef_dihedral_restraint.upper_limit _nef_dihedral_restraint.name 1 1 A 2 GLU C A 3 CYS N A 3 CYS CA A 3 CYS C 1.0 -170.2 -130.2 PHI 2 2 A 3 CYS N A 3 CYS CA A 3 CYS C A 4 GLY N 1.0 142.9 182.9 PSI 3 3 A 4 GLY C A 5 LYS N A 5 LYS CA A 5 LYS C 1.0 -137.7 -49.2 PHI 4 4 A 5 LYS N A 5 LYS CA A 5 LYS C A 6 PHE N 1.0 111.1 168.1 PSI 5 5 A 9 LYS C A 10 CYS N A 10 CYS CA A 10 CYS C 1.0 -169.1 -129.1 PHI 6 6 A 10 CYS N A 10 CYS CA A 10 CYS C A 11 LYS N 1.0 140.4 180.4 PSI 7 7 A 11 LYS C A 12 ASN N A 12 ASN CA A 12 ASN C 1.0 -177.2 -113.7 PHI 8 8 A 12 ASN N A 12 ASN CA A 12 ASN C A 13 SER N 1.0 136.3 179.7 PSI 9 9 A 12 ASN C A 13 SER N A 13 SER CA A 13 SER C 1.0 -81.9 -41.9 PHI 10 10 A 13 SER N A 13 SER CA A 13 SER C A 14 ASN N 1.0 -49.5 -9.5 PSI 11 11 A 13 SER C A 14 ASN N A 14 ASN CA A 14 ASN C 1.0 -91.1 -51.1 PHI 12 12 A 14 ASN N A 14 ASN CA A 14 ASN C A 15 ASP N 1.0 -32.3 7.7 PSI 13 13 A 14 ASN C A 15 ASP N A 15 ASP CA A 15 ASP C 1.0 -107.0 -67.0 PHI 14 14 A 15 ASP N A 15 ASP CA A 15 ASP C A 16 CYS N 1.0 -28.7 11.3 PSI 15 15 A 15 ASP C A 16 CYS N A 16 CYS CA A 16 CYS C 1.0 -138.0 -61.3 PHI 16 16 A 16 CYS N A 16 CYS CA A 16 CYS C A 17 CYS N 1.0 112.1 169.3 PSI 17 17 A 18 LYS C A 19 ASP N A 19 ASP CA A 19 ASP C 1.0 44.9 84.9 PHI 18 18 A 19 ASP N A 19 ASP CA A 19 ASP C A 20 LEU N 1.0 1.4 43.5 PSI 19 19 A 19 ASP C A 20 LEU N A 20 LEU CA A 20 LEU C 1.0 -133.3 -88.6 PHI 20 20 A 20 LEU N A 20 LEU CA A 20 LEU C A 21 VAL N 1.0 117.7 162.1 PSI 21 21 A 20 LEU C A 21 VAL N A 21 VAL CA A 21 VAL C 1.0 -158.4 -105.9 PHI 22 22 A 21 VAL N A 21 VAL CA A 21 VAL C A 22 CYS N 1.0 128.6 174.0 PSI 23 23 A 21 VAL C A 22 CYS N A 22 CYS CA A 22 CYS C 1.0 -115.6 -58.0 PHI 24 24 A 22 CYS N A 22 CYS CA A 22 CYS C A 23 SER N 1.0 106.0 146.0 PSI 25 25 A 22 CYS C A 23 SER N A 23 SER CA A 23 SER C 1.0 -109.4 -54.5 PHI 26 26 A 23 SER N A 23 SER CA A 23 SER C A 24 SER N 1.0 93.4 133.4 PSI 27 27 A 23 SER C A 24 SER N A 24 SER CA A 24 SER C 1.0 -88.7 -48.7 PHI 28 28 A 24 SER N A 24 SER CA A 24 SER C A 25 ARG N 1.0 -48.0 -8.0 PSI 29 29 A 24 SER C A 25 ARG N A 25 ARG CA A 25 ARG C 1.0 -86.9 -46.9 PHI 30 30 A 25 ARG N A 25 ARG CA A 25 ARG C A 26 TRP N 1.0 -57.6 -17.6 PSI 31 31 A 26 TRP C A 27 LYS N A 27 LYS CA A 27 LYS C 1.0 34.4 74.4 PHI 32 32 A 27 LYS N A 27 LYS CA A 27 LYS C A 28 TRP N 1.0 25.7 65.7 PSI 33 33 A 27 LYS C A 28 TRP N A 28 TRP CA A 28 TRP C 1.0 -164.0 -63.0 PHI 34 34 A 28 TRP N A 28 TRP CA A 28 TRP C A 29 CYS N 1.0 109.8 176.7 PSI 35 35 A 28 TRP C A 29 CYS N A 29 CYS CA A 29 CYS C 1.0 -99.5 -56.6 PHI 36 36 A 29 CYS N A 29 CYS CA A 29 CYS C A 30 VAL N 1.0 114.9 158.9 PSI 37 37 A 29 CYS C A 30 VAL N A 30 VAL CA A 30 VAL C 1.0 -156.5 -114.2 PHI 38 38 A 30 VAL N A 30 VAL CA A 30 VAL C A 31 LEU N 1.0 136.0 179.4 PSI 39 39 A 32 ALA C A 33 SER N A 33 SER CA A 33 SER C 1.0 -95.3 -42.2 PHI 40 40 A 33 SER N A 33 SER CA A 33 SER C A 34 PRO N 1.0 115.7 163.2 PSI 41 41 A 1 SER C A 2 GLU N A 2 GLU CA A 2 GLU C 1.0 -165.3 -27.1 PHI 42 42 A 2 GLU N A 2 GLU CA A 2 GLU C A 3 CYS N 1.0 114.5 174.1 PSI 43 43 A 5 LYS C A 6 PHE N A 6 PHE CA A 6 PHE C 1.0 -88.0 -48.0 PHI 44 44 A 6 PHE N A 6 PHE CA A 6 PHE C A 7 MET N 1.0 118.8 161.5 PSI 45 45 A 6 PHE C A 7 MET N A 7 MET CA A 7 MET C 1.0 -90.0 -50.0 PHI 46 46 A 7 MET N A 7 MET CA A 7 MET C A 8 TRP N 1.0 -53.4 -13.4 PSI 47 47 A 16 CYS C A 17 CYS N A 17 CYS CA A 17 CYS C 1.0 -169.2 -29.2 PHI 48 48 A 17 CYS N A 17 CYS CA A 17 CYS C A 18 LYS N 1.0 112.0 187.1 PSI 49 49 A 25 ARG C A 26 TRP N A 26 TRP CA A 26 TRP C 1.0 -133.4 -76.1 PHI 50 50 A 26 TRP N A 26 TRP CA A 26 TRP C A 27 LYS N 1.0 -19.5 21.9 PSI 51 51 A 30 VAL C A 31 LEU N A 31 LEU CA A 31 LEU C 1.0 -93.5 -53.5 PHI 52 52 A 31 LEU N A 31 LEU CA A 31 LEU C A 32 ALA N 1.0 112.3 158.0 PSI 53 53 A 31 LEU C A 32 ALA N A 32 ALA CA A 32 ALA C 1.0 -86.8 -46.8 PHI 54 54 A 32 ALA N A 32 ALA CA A 32 ALA C A 33 SER N 1.0 116.5 168.2 PSI stop_ save_